| SpectraBase Compound ID | 4fv2MKLTTqA |
|---|---|
| InChI | InChI=1S/C10H7IO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h4-7H,1H3 |
| InChIKey | MQBHSZHCODAMGN-UHFFFAOYSA-N |
| Mol Weight | 270.07 g/mol |
| Molecular Formula | C10H7IO |
| Exact Mass | 269.95416 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Cgpm4eT9TAm |
|---|---|
| Name | 4-(4-Iodophenyl)but-3-yn-2-one |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H7IO |
| InChI | InChI=1S/C10H7IO/c1-8(12)2-3-9-4-6-10(11)7-5-9/h4-7H,1H3 |
| InChIKey | MQBHSZHCODAMGN-UHFFFAOYSA-N |
| Molecular Weight | 270.069 g/mol |
| SMILES | C(#Cc1ccc(cc1)I)C(=O)C |
| SPLASH | splash10-0a4i-0090000000-b974d445c799c69e3d81 |
| Source of Spectrum | F4-44-1572-2h |
| Wiley ID | 1707148 |